Indolylacryloylglycine

Base Information

Chemical Name:Indolylacryloylglycine
CAS No.:61994-17-0
Molecular Formula:C13H12N2O3
Molecular Weight:
Hs Code.:
UNII:NEY8PP6VM8
Nikkaji Number:J981.201F
Wikipedia:Indolyl-3-acryloylglycine
Wikidata:Q15411025
Metabolomics Workbench ID:38793

Synonyms:indoleacrylic glycine;indolyl-3-acryloylglycine;indolylacryloylglycine;indolylacryloylglycine, (E)-isomer

Suppliers and Price of Indolylacryloylglycine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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Total 0 raw suppliers

Chemical Property of Indolylacryloylglycine

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:244.08479225
Heavy Atom Count:18
Complexity:354

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C(=CN2)C=CC(=O)NCC(=O)O
Isomeric SMILES:C1=CC=C2C(=C1)C(=CN2)/C=C/C(=O)NCC(=O)O

Technology Process of Indolylacryloylglycine

There total 3 articles about Indolylacryloylglycine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 37.0%

: (E)-N-[3-(1H-indol-3-yl)acryloyl]glycine methyl ester

: 61994-17-0
trans-N-[3-(1H-indol-3-yl)acryloyl]glycine

Guidance literature:: With phosphate buffer; pig liver esterase (E_.C_. 3.1.1.1); In acetone; for 120h; pH=8;
DOI:10.1211/0022357021778349

Reference yield:

: 1204-06-4,29953-71-7
trans-3-indole-acrylic acid

: 61994-17-0
trans-N-[3-(1H-indol-3-yl)acryloyl]glycine

Guidance literature:: Multi-step reaction with 2 steps

1: 71 percent / 2-chloro-1-methylpyridinium iodide; tri-n-butylamine / CH₂Cl₂ / 24 h

2: 37 percent / aq. phosphate buffer; pig liver esterase (E_.C_. 3.1.1.1) / acetone / 120 h / pH 8

With phosphate buffer; tributyl-amine; pig liver esterase (E_.C_. 3.1.1.1); 2-chloro-1-methyl-pyridinium iodide; In dichloromethane; acetone; 1: Mukaiyama coupling;
DOI:10.1211/0022357021778349